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CAS 1187929-25-4 2-Morpholineacetic acid HCl molecular structure lightbox
CAS RN: 1187929-25-4

2-Morpholineacetic acid HCl

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260402 100mg Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS1187929-25-4
  • Purity/Analytical Methods: >99.0%
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1187929-25-4 / 2-morpholin-2-ylacetic acid;hydrochloride

2-(Morpholin-3-yl)acetic acid hydrochloride | MORPHOLIN-3-YL-ACETIC ACID HYDROCHLORIDE | MFCD11506159

Standard CAS: 1187929-25-4 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
1187929-25-4
Multi CAS
Yes
Molecular Formula
C6H12ClNO3
Molecular Weight
181.620000
Exact Mass
181.050571
SMILES
C1COC(CN1)CC(=O)O.Cl
InChI
InChI=1S/C6H11NO3.ClH/c8-6(9)3-5-4-7-1-2-10-5;/h5,7H,1-4H2,(H,8,9);1H
InChIKey
ZLGFQSPNFIEARF-UHFFFAOYSA-N
Synonyms
2-(Morpholin-3-yl)acetic acid hydrochloride MORPHOLIN-3-YL-ACETIC ACID HYDROCHLORIDE MFCD11506159 Morpholin-3-yl-acetic acid HCl 2-morpholin-3-ylacetic acid;hydrochloride

Computed Properties

Structural Parameters

Heavy atom count
11
Fraction Csp3
0.83
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
2
Molar refractivity
42.11
TPSA
58.56

LogP / Solubility

WLOGP
-0.13
MLOGP
-0.12
XLogP3
-0.13
Consensus LogP
-0.13
Log S (ESOL)
-0.75
Class (ESOL)
Very soluble
Log S (Ali)
-0.96
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.97
Class (SILICOS-IT)
Very soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.92

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2

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